SCHEMBL28797771

SCHEMBL28797771

CC(=O)OCCOc1ccc(-c2ccc(C3C(=O)Oc4c3cc(C(C)(C)C)cc4C(C)(C)C)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
P2RY12 Q9H244 1/20 0.34
PPARG P37231 3/20 0.34
PPARA Q07869 2/20 0.34
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
GABBR2 O75899 1/20 0.32
GABBR1 Q9UBS5 1/20 0.32
FFAR1 O14842 1/20 0.32
PPARD Q03181 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL39951 0.97 APP (0.36) APPPDE3BPDE3AP2RY12PPARG
SCHEMBL30530272 0.91 APP (0.33) APPPDE3BPDE3AP2RY12PPARG
SCHEMBL21183326 0.89 GABBR2 (0.33) PPARGPPARAALDH1A1HPGDGABBR2
SCHEMBL26459763 0.89 ALDH1A1 (0.36) PPARGALDH1A1HPGDGABBR2GABBR1
SCHEMBL10153920 0.89 HTT (0.34) PPARGPPARAALDH1A1HPGDGABBR2
SCHEMBL984668 0.88 DGKA (0.34) ESR1ESR2
SCHEMBL12679255 0.88 MEN1 (0.35) PPARGPPARAALDH1A1HPGDGABBR2
SCHEMBL493787 0.87 SMN1; SMN2 (0.37) PPARGPPARAALDH1A1HPGDGABBR2
SCHEMBL29478052 0.87 SMN1; SMN2 (0.37) PPARGPPARAALDH1A1HPGDGABBR2
SCHEMBL8482548 0.87 PPARG (0.37) APPPDE3BPDE3AP2RY12PPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114786946-A Light stabilizer mixture 巴斯夫欧洲公司 2022-07-22 CN disclosed